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PyDISH No: 08055

PDB: 4coh,
chainID: B, resSeq: 1450
heme type: B

distortion

Protein data

function: oxidoreductase
experiment: X-RAY DIFFRACTION
resolution: 2.08 Å
origomeric count: 1

axial ligand #1: CYS

chainID: B,
resSeq: 422,
Coordination distance[Å]: 2.301
molecule: STEROL 14-ALPHA DEMETHYLASE
EC number: 1.14.13.70
Organism: TRYPANOSOMA CRUZI

axial ligand #2: T9H

chainID: B,
resSeq: 1460,
Coordination distance[Å]: 2.112
molecule: 2-fluoranyl-N-[(2R)-3-(1H-indol-3-yl)-1-oxidanylidene-1-(pyridin-4-ylamino)propan-2-yl]-4-(4-thiophen-2-ylsulfonylpiperazin-1-yl)benzamide

List of other hemes in pdb:4coh

ID of heme Distortion Axial ligands on heme Function & structure
4coh-A-1450
sad. +0.04
ruf. -0.89
dom. +0.03
bre. -0.31
CYS chainID: A,
resSeq: 422,
molecule: STEROL 14-ALPHA DEMETHYLASE
oxidoreductase
oligomeric count: 1
pocket vol.: 487.0 Å3
d(Fe-oop): 0.018 Å
T9H chainID: A, resSeq: 1460,
molecule: 2-fluoranyl-N-[(2R)-3-(1H-indol-3-yl)-1-oxidanylidene-1-(pyridin-4-ylamino)propan-2-yl]-4-(4-thiophen-2-ylsulfonylpiperazin-1-yl)benzamide